cobalt(3+); 1,10-phenanthroline; triperchlorate

Systemtic Name: cobalt(3+); 1,10-phenanthroline; triperchlorate Openeye Name: cobaltic 1,10-phenanthroline triperchlorate CAS Name: cobalt(3+); 1,10-phenanthroline; triperchlorate IUPAC Name: cobalt(3+); 1,10-phenanthroline; triperchlorate Traditional Name: cobaltic 1,10-phenanthroline triperchlorate Formula: C36H24Cl3CoN6O12 MolecularWeight: 897.90096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Co+3]

Isomeric SMILES

C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Co+3]

InChI

InChI=1S/3C12H8N2.3ClHO4.Co/c3*1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1;3*2-1(3,4)5;/h3*1-8H;3*(H,2,3,4,5);/q;;;;;;+3/p-3